CID 1827586
S-indacene-4-butanamine, 1,2,3,5,6,7-hexahydro-n,n-dimethyl-, hydrochloride
Structural Information
- Molecular Formula
- C18H27N
- SMILES
- CN(C)CCCCC1=C2CCCC2=CC3=C1CCC3
- InChI
- InChI=1S/C18H27N/c1-19(2)12-4-3-9-18-16-10-5-7-14(16)13-15-8-6-11-17(15)18/h13H,3-12H2,1-2H3
- InChIKey
- PZGZGSYRQUAJKG-UHFFFAOYSA-N
- Compound name
- 4-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-N,N-dimethylbutan-1-amine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 258.22164 | 166.7 |
[M+Na]+ | 280.20358 | 171.8 |
[M-H]- | 256.20708 | 172.4 |
[M+NH4]+ | 275.24818 | 189.7 |
[M+K]+ | 296.17752 | 168.0 |
[M+H-H2O]+ | 240.21162 | 160.3 |
[M+HCOO]- | 302.21256 | 187.9 |
[M+CH3COO]- | 316.22821 | 204.8 |
[M+Na-2H]- | 278.18903 | 166.9 |
[M]+ | 257.21381 | 167.0 |
[M]- | 257.21491 | 167.0 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.