CID 11217541

94568-76-0

Structural Information

Molecular Formula
C12H17N
SMILES
CC1CC(C2=C1C(=CC=C2)N)(C)C
InChI
InChI=1S/C12H17N/c1-8-7-12(2,3)9-5-4-6-10(13)11(8)9/h4-6,8H,7,13H2,1-3H3
InChIKey
KYWYAWFSWFSPAY-UHFFFAOYSA-N
Compound name
1,1,3-trimethyl-2,3-dihydroinden-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

211
Patents

175.1361 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.14338 138.2
[M+Na]+ 198.12532 147.7
[M-H]- 174.12882 143.0
[M+NH4]+ 193.16992 163.7
[M+K]+ 214.09926 144.2
[M+H-H2O]+ 158.13336 133.7
[M+HCOO]- 220.13430 161.4
[M+CH3COO]- 234.14995 185.2
[M+Na-2H]- 196.11077 143.0
[M]+ 175.13555 137.0
[M]- 175.13665 137.0
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