CID 21806132

1-methyl-2,3-dihydro-1h-inden-1-amine hydrochloride

Structural Information

Molecular Formula
C10H13N
SMILES
CC1(CCC2=CC=CC=C21)N
InChI
InChI=1S/C10H13N/c1-10(11)7-6-8-4-2-3-5-9(8)10/h2-5H,6-7,11H2,1H3
InChIKey
MIYREUVTAYSNII-UHFFFAOYSA-N
Compound name
1-methyl-2,3-dihydroinden-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

37
Patents

147.1048 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.11208 130.1
[M+Na]+ 170.09402 138.7
[M-H]- 146.09752 134.6
[M+NH4]+ 165.13862 156.1
[M+K]+ 186.06796 135.7
[M+H-H2O]+ 130.10206 125.4
[M+HCOO]- 192.10300 154.1
[M+CH3COO]- 206.11865 144.6
[M+Na-2H]- 168.07947 137.3
[M]+ 147.10425 127.5
[M]- 147.10535 127.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe