CID 52425

73771-63-8

Structural Information

Molecular Formula
C14H14N2
SMILES
CC1=C(C=CC2=C1NC3=C2CCCC3)C#N
InChI
InChI=1S/C14H14N2/c1-9-10(8-15)6-7-12-11-4-2-3-5-13(11)16-14(9)12/h6-7,16H,2-5H2,1H3
InChIKey
GGSRSZKYYOJDNX-UHFFFAOYSA-N
Compound name
1-methyl-6,7,8,9-tetrahydro-5H-carbazole-2-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.11569 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.12297 150.2
[M+Na]+ 233.10491 162.3
[M-H]- 209.10841 152.3
[M+NH4]+ 228.14951 169.2
[M+K]+ 249.07885 153.5
[M+H-H2O]+ 193.11295 137.5
[M+HCOO]- 255.11389 166.0
[M+CH3COO]- 269.12954 161.3
[M+Na-2H]- 231.09036 154.9
[M]+ 210.11514 143.5
[M]- 210.11624 143.5
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.