CID 68260136

Rac-(1r,2s)-n1,n2-dimethyl-2,3-dihydro-1h-indene-1,2-diamine

Structural Information

Molecular Formula
C11H16N2
SMILES
CN[C@@H]1CC2=CC=CC=C2[C@@H]1NC
InChI
InChI=1S/C11H16N2/c1-12-10-7-8-5-3-4-6-9(8)11(10)13-2/h3-6,10-13H,7H2,1-2H3/t10-,11+/m1/s1
InChIKey
WZNVLAUMNLRMIW-MNOVXSKESA-N
Compound name
(1S,2R)-1-N,2-N-dimethyl-2,3-dihydro-1H-indene-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

176.13135 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.138626 137.2
[M+Na]+ 199.120568 144.2
[M-H]- 175.124074 141.8
[M+NH4]+ 194.165173 160.0
[M+K]+ 215.094508 141.3
[M+H-H2O]+ 159.128610 131.4
[M+HCOO]- 221.129551 162.4
[M+CH3COO]- 235.145201 187.1
[M+Na-2H]- 197.106016 143.6
[M]+ 176.13080142 135.2
[M]- 176.13189858 135.2
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