CID 11790505

99614-64-9

Structural Information

Molecular Formula
C14H13NO
SMILES
CN1C2=C(C3=CC=CC=C31)C(=O)C(=C)CC2
InChI
InChI=1S/C14H13NO/c1-9-7-8-12-13(14(9)16)10-5-3-4-6-11(10)15(12)2/h3-6H,1,7-8H2,2H3
InChIKey
AGQJDIDJKSFVTC-UHFFFAOYSA-N
Compound name
9-methyl-3-methylidene-1,2-dihydrocarbazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

91
Patents

211.09972 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.10700 145.5
[M+Na]+ 234.08894 160.4
[M+NH4]+ 229.13354 155.3
[M+K]+ 250.06288 153.9
[M-H]- 210.09244 148.4
[M+Na-2H]- 232.07439 151.1
[M]+ 211.09917 148.5
[M]- 211.10027 148.5
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

patents stripe