CID 6365719

Einecs 276-508-3

Structural Information

Molecular Formula
C18H16N4O2
SMILES
CC1=CC(=C(C2=C1C3=C(N2)C=CC(=C3)OC)C)/C=C/C(=O)N=[N+]=[N-]
InChI
InChI=1S/C18H16N4O2/c1-10-8-12(4-7-16(23)21-22-19)11(2)18-17(10)14-9-13(24-3)5-6-15(14)20-18/h4-9,20H,1-3H3/b7-4+
InChIKey
SPTZTMIQISNNNL-QPJJXVBHSA-N
Compound name
(E)-3-(6-methoxy-1,4-dimethyl-9H-carbazol-2-yl)prop-2-enoyl azide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.12732 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.134596 174.2
[M+Na]+ 343.116538 183.4
[M-H]- 319.120044 180.5
[M+NH4]+ 338.161143 191.0
[M+K]+ 359.090478 173.1
[M+H-H2O]+ 303.124580 170.6
[M+HCOO]- 365.125521 201.0
[M+CH3COO]- 379.141171 210.6
[M+Na-2H]- 341.101986 181.6
[M]+ 320.12677142 175.8
[M]- 320.12786858 175.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.