CID 79689677

1502054-70-7

Structural Information

Molecular Formula
C12H16N2
SMILES
CC1=C(C=CC(=C1)N2CC3(C2)CC3)N
InChI
InChI=1S/C12H16N2/c1-9-6-10(2-3-11(9)13)14-7-12(8-14)4-5-12/h2-3,6H,4-5,7-8,13H2,1H3
InChIKey
NQHQTVPOGDMMQL-UHFFFAOYSA-N
Compound name
4-(5-azaspiro[2.3]hexan-5-yl)-2-methylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.13135 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.13863 142.1
[M+Na]+ 211.12057 152.1
[M+NH4]+ 206.16517 149.6
[M+K]+ 227.09451 146.8
[M-H]- 187.12407 151.1
[M+Na-2H]- 209.10602 151.3
[M]+ 188.13080 146.3
[M]- 188.13190 146.3
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.