CID 213272

Nu-1525 hydrobromide

Structural Information

Molecular Formula
C19H21N
SMILES
CN1CCC2C(C1)C(C3=CC=CC=C23)C4=CC=CC=C4
InChI
InChI=1S/C19H21N/c1-20-12-11-16-15-9-5-6-10-17(15)19(18(16)13-20)14-7-3-2-4-8-14/h2-10,16,18-19H,11-13H2,1H3
InChIKey
YNCZOUOXGYIZTI-UHFFFAOYSA-N
Compound name
2-methyl-9-phenyl-1,3,4,4a,9,9a-hexahydroindeno[2,1-c]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

263.1674 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.174676 163.0
[M+Na]+ 286.156618 169.8
[M-H]- 262.160124 169.4
[M+NH4]+ 281.201223 181.9
[M+K]+ 302.130558 163.6
[M+H-H2O]+ 246.164660 154.4
[M+HCOO]- 308.165601 180.3
[M+CH3COO]- 322.181251 174.1
[M+Na-2H]- 284.142066 165.9
[M]+ 263.16685142 159.1
[M]- 263.16794858 159.1
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.