CID 13339188
2-amino-7-methyl-5-(4-methylphenyl)-4,5-dihydro-3h-1,3-benzodiazepine hydrochloride
Structural Information
- Molecular Formula
- C17H19N3
- SMILES
- CC1=CC=C(C=C1)C2CN=C(NC3=C2C=C(C=C3)C)N
- InChI
- InChI=1S/C17H19N3/c1-11-3-6-13(7-4-11)15-10-19-17(18)20-16-8-5-12(2)9-14(15)16/h3-9,15H,10H2,1-2H3,(H3,18,19,20)
- InChIKey
- PRCHGFMCTOSVJT-UHFFFAOYSA-N
- Compound name
- 7-methyl-5-(4-methylphenyl)-4,5-dihydro-1H-1,3-benzodiazepin-2-amine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 266.16518 | 164.1 |
[M+Na]+ | 288.14712 | 177.0 |
[M+NH4]+ | 283.19172 | 171.8 |
[M+K]+ | 304.12106 | 170.4 |
[M-H]- | 264.15062 | 168.5 |
[M+Na-2H]- | 286.13257 | 171.7 |
[M]+ | 265.15735 | 167.3 |
[M]- | 265.15845 | 167.3 |
Literature stripe
No literature data available for this compound.