CID 282359

40496-58-0

Structural Information

Molecular Formula
C14H14N2
SMILES
C1CC2=C(CC1CC#N)C3=CC=CC=C3N2
InChI
InChI=1S/C14H14N2/c15-8-7-10-5-6-14-12(9-10)11-3-1-2-4-13(11)16-14/h1-4,10,16H,5-7,9H2
InChIKey
WCVKHIRZXGSZRF-UHFFFAOYSA-N
Compound name
2-(2,3,4,9-tetrahydro-1H-carbazol-3-yl)acetonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.11569 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.12297 152.2
[M+Na]+ 233.10491 165.1
[M+NH4]+ 228.14951 158.4
[M+K]+ 249.07885 155.1
[M-H]- 209.10841 147.5
[M+Na-2H]- 231.09036 155.0
[M]+ 210.11514 151.9
[M]- 210.11624 151.9
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.